[2-acetyloxy-3-nitro-5-(2-oxidanylidene-1,4-benzoxazin-3-yl)phenyl] ethanoate

Systemtic Name: [2-acetyloxy-3-nitro-5-(2-oxidanylidene-1,4-benzoxazin-3-yl)phenyl] ethanoate Openeye Name: [2-acetoxy-3-nitro-5-(2-oxo-1,4-benzoxazin-3-yl)phenyl] acetate CAS Name: acetic acid [2-acetyloxy-3-nitro-5-(2-oxo-1,4-benzoxazin-3-yl)phenyl] ester IUPAC Name: [2-acetyloxy-3-nitro-5-(2-oxo-1,4-benzoxazin-3-yl)phenyl] acetate Traditional Name: acetic acid [2-acetoxy-5-(2-keto-1,4-benzoxazin-3-yl)-3-nitro-phenyl] ester Formula: C18H12N2O8 MolecularWeight: 384.29648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=CC(=C1OC(=O)C)[N+](=O)[O-])C2=NC3=CC=CC=C3OC2=O

Isomeric SMILES

CC(=O)OC1=CC(=CC(=C1OC(=O)C)[N+](=O)[O-])C2=NC3=CC=CC=C3OC2=O

InChI

InChI=1S/C18H12N2O8/c1-9(21)26-15-8-11(7-13(20(24)25)17(15)27-10(2)22)16-18(23)28-14-6-4-3-5-12(14)19-16/h3-8H,1-2H3